search

luc-j-bourhis / smtbx-paper

Project of publication about the smtbx a.k.a. Olex2.refine
0 stars 0 forks source link

Section on twinning needs work #9

Open luc-j-bourhis opened 11 years ago

luc-j-bourhis commented 11 years ago

[Richard's point 22] Perhaps the section on twinning, especially the description of different kind of twins could be reduced, and we just refer readers to the various Herbst-Irmer & Sheldrick papers. We could just explain the distinction in treatment of twins where the reciprocal lattices are (almost) exactly superimposed and non-merohedral twins (although I prefer the terminology "multiple lattices" here now). Speaking of the latter, hasn't Oleg implemented support for hklf5 refinement in smtbx/olex2.refine? Perhaps Oleg should add a few words here regarding his implementation.

luc-j-bourhis commented 11 years ago

I would appreciate if you and Oleg sorts this out as my contribution to this area amounts to exactly 0.